CS-0572927
Tert-butyl ((5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)piperidin-3-yl)(2,2,2-trifluoroethyl)carbamate
Manufacturer: ChemScene
CAS Number: 1456803-34-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₁H₂₆F₆N₂O₃
Molecular Weight
468.43
Synonyms
Carbamic acid, N-[(5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-N-(2,2,2-trifluoroethyl)-, 1,1-dimethylethyl ester
SMILES
O=C(OC(C)(C)C)N(C1C(N(CC(F)(F)F)[C@H](C)[C@H](C2=CC=CC=C2)C1)=O)CC(F)(F)F
Tpsa
49.85
Logp
5.1213
H Acceptors
3
H Donors
0
Rotatable Bonds
4
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₆F₆N₂O₃
Molecular Weight: 468.43
Synonyms: Carbamic acid, N-[(5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-N-(2,2,2-trifluoroethyl)-, 1,1-dimethylethyl ester
SMILES: O=C(OC(C)(C)C)N(C1C(N(CC(F)(F)F)[C@H](C)[C@H](C2=CC=CC=C2)C1)=O)CC(F)(F)F
Tpsa: 49.85
Logp: 5.1213
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₆F₆N₂O₃
Molecular Weight:
468.43
Synonyms:
Carbamic acid, N-[(5S,6R)-6-methyl-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3-piperidinyl]-N-(2,2,2-trifluoroethyl)-, 1,1-dimethylethyl ester
SMILES:
O=C(OC(C)(C)C)N(C1C(N(CC(F)(F)F)[C@H](C)[C@H](C2=CC=CC=C2)C1)=O)CC(F)(F)F
Tpsa:
49.85
Logp:
5.1213
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₄ClNO₃
Molecular Weight: 243.69
Synonyms: None
SMILES: COC(=O)[C@H]1C2=C(CCN1)C=C(C=C2)O.Cl
Tpsa: 58.56
Logp: 1.1738
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄ClNO₃
Molecular Weight:
243.69
Synonyms:
None
SMILES:
COC(=O)[C@H]1C2=C(CCN1)C=C(C=C2)O.Cl
Tpsa:
58.56
Logp:
1.1738
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₄INO₄
Molecular Weight: 315.11
Synonyms: N-Boc-3-iodo-L-alanine
SMILES: CC(C)(C)OC(=O)N[C@@H](CI)C(=O)O
Tpsa: 75.63
Logp: 1.3993
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₄INO₄
Molecular Weight:
315.11
Synonyms:
N-Boc-3-iodo-L-alanine
SMILES:
CC(C)(C)OC(=O)N[C@@H](CI)C(=O)O
Tpsa:
75.63
Logp:
1.3993
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₇NO₂
Molecular Weight: 101.10
Synonyms: 2-Amino-3-butenoic acid
SMILES: C=CC(C(=O)O)N
Tpsa: 63.32
Logp: -0.4157
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₇NO₂
Molecular Weight:
101.10
Synonyms:
2-Amino-3-butenoic acid
SMILES:
C=CC(C(=O)O)N
Tpsa:
63.32
Logp:
-0.4157
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2